SCHEMBL13320409

SCHEMBL13320409

CCCOC(=O)CSC(=S)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.54
TP53 P04637 1/20 0.46
HDAC3 O15379 1/20 0.44
HDAC4 P56524 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC10 Q969S8 1/20 0.44
HDAC11 Q96DB2 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
HDAC9 Q9UKV0 1/20 0.44
HDAC5 Q9UQL6 1/20 0.44
ALDH1A1 P00352 6/20 0.44
HPGD P15428 3/20 0.43
GAA P10253 2/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4231270 0.88 MAPT (0.49) LMNAHDAC3HDAC4HDAC1HDAC7
SCHEMBL13050748 0.87 TSHR (0.45) LMNAHDAC3HDAC4HDAC1HDAC7
SCHEMBL3048238 0.81 TSHR (0.46) LMNAHDAC3HDAC4HDAC1HDAC7
SCHEMBL22204622 0.80 HDAC3 (0.44) LMNAHDAC3HDAC4HDAC1HDAC7
SCHEMBL9906806 0.79 TSHR (0.38) LMNAHDAC3HDAC4HDAC1HDAC7
SCHEMBL22204623 0.78 HDAC3 (0.43) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL13829103 0.77 L3MBTL1 (0.44) LMNATP53ALDH1A1GAAL3MBTL1
SCHEMBL22848076 0.77 TSHR (0.50) LMNAHDAC3HDAC4HDAC1HDAC7
SCHEMBL18036991 0.75 ALDH1A1 (0.43) LMNAHDAC3HDAC4HDAC1HDAC7
SCHEMBL2705058 0.75 ALDH1A1 (0.52) LMNATP53HDAC3HDAC4HDAC1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7714075-B1 Polymerization with living characteristics COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2010-05-11 US disclosed
US-7666962-B2 Polymerization with living characteristics COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2010-02-23 US disclosed
US-7662986-B2 Polymerization with living characteristics COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2010-02-16 US disclosed
US-20080139836-A1 Polymerization with living characteristics LE TAM PHUONG 2008-06-12 US disclosed
US-20080139764-A1 Polymerization with living characteristics COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2008-06-12 US disclosed
US-7250479-B2 Polymerization with living characteristics E. I. DU PONT DE NEMOURS AND COMPANY (US) 2007-07-31 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080139836-A1 Polymerization with living characteristics UQCRB, MTR, UQCRC2 LMNA 3210/4885TP53 4578/4885HDAC3 2448/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.